Geometry & MOs

Info

ID:	329375
PubChem CID:	126735705
Reduced:	N2C6H11 (2)
Stoich.:	A2B6C11 (2)
Weight, g/mol:	281.14495
ΔH_f, kcal/mol:	22.49
Dipole, Da:	2.69
IP(EA), eV:	-9.52(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[4-(1-cyclobutylpropan-2-ylsulfonyl)phenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C)CC(C1=NC(=NN1C)C2CCC2)N

DOS

IR

Vibrations